Compound Identification
SMILES
OCC1=NC2=C(C=C(F)C=C2)N1CCCC#N
InChIKey
InChIKey=ZQQNQZYNVCFFPQ-UHFFFAOYSA-N
Formula
C12H12FN3O
Mass
233.246
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzimidazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzimidazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzimidazoles
Alternative Parents
N-substituted imidazoles Benzenoids Aryl fluorides Heteroaromatic compounds Nitriles Azacyclic compounds Primary alcohols Organofluorides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Aryl fluoride - Aryl halide - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Azole - Imidazole - Azacycle - Carbonitrile - Nitrile - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Cyanide - Alcohol - Aromatic alcohol - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
External Descriptors
Not available